[(E)-3-phenylprop-2-enyl] 4-methylbenzenesulfonate

Systemtic Name: [(E)-3-phenylprop-2-enyl] 4-methylbenzenesulfonate Openeye Name: [(E)-cinnamyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(E)-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-3-phenylprop-2-enyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(E)-cinnamyl] ester Formula: C16H16O3S MolecularWeight: 288.36144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC=CC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC/C=C/C2=CC=CC=C2

InChI

InChI=1S/C16H16O3S/c1-14-9-11-16(12-10-14)20(17,18)19-13-5-8-15-6-3-2-4-7-15/h2-12H,13H2,1H3/b8-5+